HRID144126

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)S(=O)(=O)c1ccccc1Nc1nc(Cl)ncc1Cl

HCID59764378

2,5-Dichloro-N-[2-(propane-2-sulfonyl)phenyl]pyrimidin-4-amine

C13H13Cl2N3O2S

HCID67264281

未命名化合物

PRODUCTS

生成物

结构：CCN1CCN(CC)c2cc(Nc3ncc(Cl)c(Nc4ccccc4S(=O)(=O)C(C)C)n3)ccc2C1

HCID67264590

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-538cdb7f61f545149992c4d94fad4836
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:1]([CH3:2])[N:3]1[CH2:4][CH2:5][N:6]([CH2:15][CH3:16])[CH2:7][c:8]2[c:9]1[cH:10][c:11]([NH2:14])[cH:12][cH:13]2.[Cl:17][c:18]1[n:19][cH:20][c:21]([Cl:37])[c:22]([NH:24][c:25]2[c:26]([S:31](=[O:32])(=[O:33])[CH:34]([CH3:35])[CH3:36])[cH:27][cH:28][cH:29][cH:30]2)[n:23]1>>[CH2:1]([CH3:2])[N:3]1[CH2:4][CH2:5][N:6]([CH2:15][CH3:16])[CH2:7][c:8]2[c:9]1[cH:10][c:11]([NH:14][c:18]1[n:19][cH:20][c:21]([Cl:37])[c:22]([NH:24][c:25]3[c:26]([S:31](=[O:32])(=[O:33])[CH:34]([CH3:35])[CH3:36])[cH:27][cH:28][cH:29][cH:30]3)[n:23]1)[cH:12][cH:13]2